2-[4-chloranyl-6-[(2,3-dimethylphenyl)amino]pyrimidin-2-yl]sulfanyl-2-morpholin-4-yl-ethanamide

Systemtic Name: 2-[4-chloranyl-6-[(2,3-dimethylphenyl)amino]pyrimidin-2-yl]sulfanyl-2-morpholin-4-yl-ethanamide Openeye Name: 2-[4-chloro-6-(2,3-dimethylanilino)pyrimidin-2-yl]sulfanyl-2-morpholino-acetamide CAS Name: 2-[[4-chloro-6-(2,3-dimethylanilino)-2-pyrimidinyl]thio]-2-(4-morpholinyl)acetamide IUPAC Name: 2-[4-chloro-6-(2,3-dimethylanilino)pyrimidin-2-yl]sulfanyl-2-morpholin-4-ylacetamide Traditional Name: 2-[[4-chloro-6-(2,3-dimethylanilino)pyrimidin-2-yl]thio]-2-morpholino-acetamide Formula: C18H22ClN5O2S MolecularWeight: 407.91758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC2=CC(=NC(=N2)SC(C(=O)N)N3CCOCC3)Cl)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC2=CC(=NC(=N2)SC(C(=O)N)N3CCOCC3)Cl)C

InChI

InChI=1S/C18H22ClN5O2S/c1-11-4-3-5-13(12(11)2)21-15-10-14(19)22-18(23-15)27-17(16(20)25)24-6-8-26-9-7-24/h3-5,10,17H,6-9H2,1-2H3,(H2,20,25)(H,21,22,23)